Dongqing Wei

Tenured Professor

  • Tel: +86-021-34204573
  • Email: dqwei@sjtu.edu.cn
  • Lab Web: tacc2008.sjtu.edu.cn
  • Tenured professor, editor-in-chief, Interdisciplinary Sciences – Computational Life Sciences, a Scoup highly cited scholar, published 600 papers with more than 10000 citations, a H-index 60, H10-index 235. Made many ground breeking contributions to science.

Selected Publications

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    Cited 78 times -Jing Chang, Peng Lian, Dong-Qing Wei*, Xiang-Rong Chen, Zizheng Gong and Qingming Zhang, “Thermal decomposition of the solid phase of nitromethane: Ab initio molecular dynamics simulations”, Phys. Rev. Lett. 105, 188302 -188305(2010).

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    Cited 34 times -Ruo-Xu Gu, Limin Angela Liu*, and Dong-Qing Wei*, “Free Energy Calculations on the Two Drug Binding Sites in the M2 Proton Channel”, J. Am. Chem. Soc., 133 (28), 10817–10825(2011).

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    Cited 45 times - Maoping Tang, Zhaoxia Wang, Ying Zhou, Wangjie Xu, Shengtian Li,Lianyun Wang, Dong-Qing Wei*, Zhongdong Qiao*, “A novel drug candidate for Alzheimer disease treatment - gx-50 derived from Zanthoxylum Bungeanum”, J. Alzheimer’s Disease, 34, 203–213 (2013).

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    (Cited 341 times) Wei, D. and G. Patey, "Orientational order in simple dipolar liquids: computer simulation of a ferroelectric nematic phase". Physical review letters, 1992. 68(13): p. 2043-2045.

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    (Cited 180 times) Wei, D. and D. Salahub, "Hydrated proton clusters and solvent effects on the proton transfer barrier: A density functional study". The Journal of chemical physics, 1994. 101(9): p. 7633-7642.

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    (Cited 68 times) Chu, Y., A.C. Kaushik, X. Wang, W. Wang, Y. Zhang, X. Shan, D.R. Salahub, Y. Xiong, and Wei D.Q., "DTI-CDF: a cascade deep forest model towards the prediction of drug-target interactions based on hybrid features". Briefings in Bioinformatics, 2019, doi: 10.1093/bib/bbz152.

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    (Cited 66 times) Wang, C., Wang, S., Li, D., Wei, D.Q.*, Zhao, J*. and Wang, J.*, “Human intestinal defensin 5 inhibits SARS-CoV-2 invasion by cloaking ACE2”. Gastroenterology, 2020, DOI: 10.1053/j.gastro.2020.05.015.

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    (Cited 0 times)  Chu, Y., Zhang, Y., Wang , Q.K., Zhang, L.F.,  Wang, X.H., Wang, Y.J., , Salahub, D.R., Xu, Q.., Wang, J.M., Jiang,  X., Xiong, Y*,  and Wei, D.Q.*,  “A transformer-based model to predict peptide–HLA class I binding and optimize mutated peptides for vaccine design”,  Nature Machine Intelligence, 2022, 4(3):300-311, DOI: 10.1038/s42256-022-00459-7 (2021).